Monomers

Methyl acrylate

Identifiers

IUPAC name
methyl prop-2-enoate
InchI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InchI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
SMILES
COC(=O)C=C
Canonical SMILES
COC(=O)C=C
Isomeric SMILES
COC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.3454
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
    2.0792   -0.4593    0.0658 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6817   -0.5605   -0.1410 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0592    0.6115    0.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5014    1.6865    0.3595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5028    0.6430   -0.1466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1453   -0.4749   -0.4916 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5572   -1.2890   -0.4908 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3042   -0.5204    1.1702 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4017    0.5366   -0.2990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0343    1.5778    0.0018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2130   -0.3947   -0.6129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5707   -1.3566   -0.6219 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  1  7  1  0
  1  8  1  0
  1  9  1  0
  5 10  1  0
  6 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers